| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2007 | 30 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.13 | 5.65 | -34.62 | 0 | 7 | -1 | 86 | 410.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 7.5 | -48.26 | 2 | 7 | 1 | 84 | 412.441 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.55 | 7.86 | -51.46 | 1 | 7 | 1 | 81 | 412.441 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 7.98 | -47.68 | 1 | 7 | 0 | 87 | 411.433 | 6 | ↓ |
